SCHEMBL6266965

SCHEMBL6266965

CC1(C)C(OC=O)C1(Cl)Cl

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2079147 0.79
SCHEMBL20787017 0.73 TDP1 (0.33)
SCHEMBL11077125 0.69
SCHEMBL9789523 0.67
SCHEMBL9807933 0.67
SCHEMBL11659530 0.63
SCHEMBL11429716 0.62
SCHEMBL6309164 0.61
SCHEMBL4448362 0.61
SCHEMBL7813764 0.61

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1025757-B1 Crop protection emulsifiable concentrate containing defoaming agents BASF AGRO B V ARNHEM NL WAEDEN (CH) 2005-11-09 EP disclosed
US-6566308-B1 For crop protection active compounds BASF AKTIENGESELLSCHAFT (DE) 2003-05-20 US disclosed
US-6444618-B1 NONAQUEOUS EMULSIFIABLE CONCENTRATE WHICH COMPRISES PESTICIDE, NONPOLAR ORGANIC SOLVENT, POLAR APROTIC COSOLVENT, EMULSIFYING SURFACTANT SYSTEM ENABLING OIL-IN-WATER EMULSION TO BE FORMED IN WATER, DEFOAMING AGENT BASF AKTIENGESELLSCHAFT (DE) 2002-09-03 US disclosed
EP-1025757-A1 Crop protection emulsifiable concentrate containing defoaming agents American Cyanamid Company (US) 2000-08-09 EP disclosed
EP-1023833-A2 Emulsifiable concentrate containing one or more pesticides and adjuvants American Cyanamid Company (US) 2000-08-02 EP disclosed
EP-0196156-B1 FLUOROBENZYL ESTERS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-02-07 EP disclosed
EP-0196156-A1 Fluorobenzyl esters IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-10-01 EP disclosed